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Home > Indoles and Oxindole > 919800-49-0
919800-49-0 | 1H-Isoindol-1-one, 2,3-dihydro-7-hydroxy-2-methyl-4-(phenylmethoxy)-
CAS No: 919800-49-0 Catalog No: AG006GY3 MDL No:
Product Description
Catalog Number:
AG006GY3
Chemical Name:
1H-Isoindol-1-one, 2,3-dihydro-7-hydroxy-2-methyl-4-(phenylmethoxy)-
CAS Number:
919800-49-0
Molecular Formula:
C16H15NO3
Molecular Weight:
269.2952
IUPAC Name:
7-hydroxy-2-methyl-4-phenylmethoxy-3H-isoindol-1-one
InChI:
InChI=1S/C16H15NO3/c1-17-9-12-14(8-7-13(18)15(12)16(17)19)20-10-11-5-3-2-4-6-11/h2-8,18H,9-10H2,1H3
InChI Key:
LJCOCBOYXWVBGG-UHFFFAOYSA-N
SMILES:
CN1Cc2c(C1=O)c(O)ccc2OCc1ccccc1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.3g/mol
Monoisotopic Mass:
269.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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